UCSF

ZINC00333995

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.75 6.56 -11.86 0 4 0 44 190.202 3

Vendor Notes

Note Type Comments Provided By
MP 74 - 76 Enamine Building Blocks
MP 74...76 Enamine Building Blocks
Melting_Point 78-80? Alfa-Aesar
melting_point 80 - 81 KeyOrganics
MP 88-90° Matrix Scientific
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.